EP2175390A4 - Procédé de simulation de molécule, dispositif de simulation de molécule, programme de simulation de molécule et support d'enregistrement enregistrant le programme - Google Patents

Procédé de simulation de molécule, dispositif de simulation de molécule, programme de simulation de molécule et support d'enregistrement enregistrant le programme

Info

Publication number
EP2175390A4
EP2175390A4 EP08752887.3A EP08752887A EP2175390A4 EP 2175390 A4 EP2175390 A4 EP 2175390A4 EP 08752887 A EP08752887 A EP 08752887A EP 2175390 A4 EP2175390 A4 EP 2175390A4
Authority
EP
European Patent Office
Prior art keywords
program
molecule simulation
molecule
recording medium
recording
Prior art date
Legal status (The legal status is an assumption and is not a legal conclusion. Google has not performed a legal analysis and makes no representation as to the accuracy of the status listed.)
Withdrawn
Application number
EP08752887.3A
Other languages
German (de)
English (en)
Other versions
EP2175390A1 (fr
Inventor
Daiji Ichishima
Yoshitaka Ohnishi
Current Assignee (The listed assignees may be inaccurate. Google has not performed a legal analysis and makes no representation or warranty as to the accuracy of the list.)
Sumitomo Heavy Industries Ltd
Original Assignee
Sumitomo Heavy Industries Ltd
Priority date (The priority date is an assumption and is not a legal conclusion. Google has not performed a legal analysis and makes no representation as to the accuracy of the date listed.)
Filing date
Publication date
Application filed by Sumitomo Heavy Industries Ltd filed Critical Sumitomo Heavy Industries Ltd
Publication of EP2175390A1 publication Critical patent/EP2175390A1/fr
Publication of EP2175390A4 publication Critical patent/EP2175390A4/fr
Withdrawn legal-status Critical Current

Links

Classifications

    • G—PHYSICS
    • G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
    • G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
    • G16C10/00—Computational theoretical chemistry, i.e. ICT specially adapted for theoretical aspects of quantum chemistry, molecular mechanics, molecular dynamics or the like

Landscapes

  • Engineering & Computer Science (AREA)
  • Computing Systems (AREA)
  • Theoretical Computer Science (AREA)
  • Physics & Mathematics (AREA)
  • Health & Medical Sciences (AREA)
  • General Health & Medical Sciences (AREA)
  • Spectroscopy & Molecular Physics (AREA)
  • Life Sciences & Earth Sciences (AREA)
  • Bioinformatics & Cheminformatics (AREA)
  • Bioinformatics & Computational Biology (AREA)
  • Management, Administration, Business Operations System, And Electronic Commerce (AREA)
  • Complex Calculations (AREA)
EP08752887.3A 2007-07-31 2008-05-16 Procédé de simulation de molécule, dispositif de simulation de molécule, programme de simulation de molécule et support d'enregistrement enregistrant le programme Withdrawn EP2175390A4 (fr)

Applications Claiming Priority (2)

Application Number Priority Date Filing Date Title
JP2007199646A JP5052985B2 (ja) 2007-07-31 2007-07-31 分子シミュレーション方法、分子シミュレーション装置、分子シミュレーションプログラム、及び該プログラムを記録した記録媒体
PCT/JP2008/059054 WO2009016873A1 (fr) 2007-07-31 2008-05-16 Procédé de simulation de molécule, dispositif de simulation de molécule, programme de simulation de molécule et support d'enregistrement enregistrant le programme

Publications (2)

Publication Number Publication Date
EP2175390A1 EP2175390A1 (fr) 2010-04-14
EP2175390A4 true EP2175390A4 (fr) 2016-03-09

Family

ID=40304113

Family Applications (1)

Application Number Title Priority Date Filing Date
EP08752887.3A Withdrawn EP2175390A4 (fr) 2007-07-31 2008-05-16 Procédé de simulation de molécule, dispositif de simulation de molécule, programme de simulation de molécule et support d'enregistrement enregistrant le programme

Country Status (6)

Country Link
US (1) US8280699B2 (fr)
EP (1) EP2175390A4 (fr)
JP (1) JP5052985B2 (fr)
KR (1) KR101090769B1 (fr)
CN (1) CN101779205A (fr)
WO (1) WO2009016873A1 (fr)

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JP5777506B2 (ja) 2011-12-26 2015-09-09 住友重機械工業株式会社 解析装置およびシミュレーション方法
JP5844165B2 (ja) * 2012-01-26 2016-01-13 住友重機械工業株式会社 解析装置
US8855982B2 (en) 2012-02-06 2014-10-07 Sumitomo Heavy Industries, Ltd. Analysis device and simulation method
JP5839473B2 (ja) 2012-03-02 2016-01-06 住友重機械工業株式会社 解析装置
WO2014045492A1 (fr) * 2012-09-21 2014-03-27 住友重機械工業株式会社 Dispositif d'analyse
JP6053418B2 (ja) * 2012-09-21 2016-12-27 住友重機械工業株式会社 解析方法および解析装置
JP6249912B2 (ja) 2013-11-01 2017-12-20 住友重機械工業株式会社 解析装置
CN105760598A (zh) * 2016-02-15 2016-07-13 哈尔滨理工大学 一种基于分子动力学模拟的纳米材料塑性模量计算方法
KR102429489B1 (ko) 2017-07-21 2022-08-05 현대자동차주식회사 조립화 분자동력학 시뮬레이션의 파라미터 최적 설정방법 및 이를 이용한 유체의 유동 구현방법
KR102441072B1 (ko) 2017-10-19 2022-09-06 현대자동차주식회사 유체의 유동 구현을 위한 시뮬레이션 방법
WO2019171660A1 (fr) 2018-03-07 2019-09-12 住友重機械工業株式会社 Dispositif d'analyse de champ magnétique, procédé d'analyse et programme
JP7117973B2 (ja) * 2018-10-30 2022-08-15 住友重機械工業株式会社 シミュレーション装置、シミュレーション方法、及びプログラム
JP2021110997A (ja) * 2020-01-07 2021-08-02 住友重機械工業株式会社 シミュレーション方法、シミュレーション装置、及びプログラム
US11947881B2 (en) 2020-06-26 2024-04-02 Loram Technologies, Inc. Method and system for performing and comparing financial analysis of different rail life scenarios in a rail system
KR102628495B1 (ko) * 2020-12-16 2024-01-24 한국과학기술원 나노 입자의 3차원 원자 단위 구조 결정 장치 및 그 결정 방법
CN112669911B (zh) * 2021-01-18 2022-09-23 广西中医药大学 一种药物分子动力学模拟限制势方法及系统
CN113850801B (zh) * 2021-10-18 2024-09-13 深圳晶泰科技有限公司 晶型预测方法、装置及电子设备
KR20230066842A (ko) 2021-11-08 2023-05-16 현대자동차주식회사 양자컴퓨터를 이용한 양자상태 시뮬레이션 방법 및 그 양자컴퓨터
CN114239374B (zh) * 2021-12-31 2024-08-27 华侨大学 基于晶格常数的单晶材料势函数修正方法

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Also Published As

Publication number Publication date
KR20100029248A (ko) 2010-03-16
US8280699B2 (en) 2012-10-02
US20100211366A1 (en) 2010-08-19
WO2009016873A1 (fr) 2009-02-05
EP2175390A1 (fr) 2010-04-14
CN101779205A (zh) 2010-07-14
JP2009037334A (ja) 2009-02-19
KR101090769B1 (ko) 2011-12-08
JP5052985B2 (ja) 2012-10-17

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